Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | LPAR3 | Q9UBY5 | 5/20 | 0.42 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.42 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | CDC25A | P30304 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.39 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | PTAFR | P25105 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Phosphocholine SCHEMBL28111186 | 0.90 | TSHR (0.54) | THRBTSHRLPAR3LPAR1LPAR2 | |
| Phosphoric Acid SCHEMBL28347815 | 0.85 | THRB (0.54) | THRBTSHRLMNAADRA1ACHRM5 | |
| Choline SCHEMBL28250828 | 0.85 | TSHR (0.49) | THRBTSHRLPAR3LPAR1LPAR2 | |
| Phosphoric Acid SCHEMBL30511659 | 0.84 | THRB (0.53) | THRBTSHRLMNAESR1ADORA3 | |
| SCHEMBL28906169 | 0.83 | TSHR (0.49) | THRBTSHRLMNAESR1ADORA3 | |
| SCHEMBL16545313 | 0.82 | THRB (0.54) | THRBTSHRLPAR3LPAR1LPAR2 | |
| SCHEMBL28041831 | 0.82 | THRB (0.61) | THRBTSHRLMNAADRA1ACHRM5 | |
| SCHEMBL28329138 | 0.82 | TSHR (0.51) | THRBTSHRLMNAESR1ADORA3 | |
| Hexane SCHEMBL1436393 | 0.81 | TSHR (0.64) | THRBTSHRLPAR3LPAR1LPAR2 | |
| SCHEMBL4066752 | 0.81 | THRB (0.59) | THRBTSHRLPAR3LPAR1LPAR2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115301214-A | Choline phosphoric acid composite magnetic nano material and preparation method and application thereof | 暨南大学 | 2022-11-08 | — | — | CN | disclosed |
| CN-115301214-A | Choline phosphoric acid composite magnetic nano material and preparation method and application thereof | 暨南大学 | 2022-11-08 | — | — | CN | disclosed |